⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21815438 | 0.61 | — | — | |
| SCHEMBL9051041 | 0.59 | SLC6A2 (0.44) | — | |
| SCHEMBL12475867 | 0.58 | — | — | |
| Hydrochloric Acid SCHEMBL15311921 | 0.57 | L3MBTL1 (0.31) | — | |
| SCHEMBL29079512 | 0.57 | — | — | |
| SCHEMBL8018826 | 0.57 | — | — | |
| SCHEMBL27872834 | 0.57 | — | — | |
| SCHEMBL3126251 | 0.57 | — | — | |
| SCHEMBL3769660 | 0.57 | CYP19A1 (0.39) | — | |
| SCHEMBL15906695 | 0.57 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2146972-A2 | HETEROCYCLIC COMPOUNDS CONTAINING THE MORPHOLINE NUCLEUS THEIR PREPARATION AND USE | Minerva Patents SA (LU) | 2010-01-27 | — | — | EP | disclosed |
| WO-2008129004-A2 | HETEROCYCLIC COMPOUNDS CONTAINING THE MORPHOLINE NUCLEUS THEIR PREPARATION AND USE | GUARNA ANTONIO (IT) | 2008-10-30 | — | — | WO | disclosed |